trimethyl-[2-(4-methylphenyl)-3-oxidanylidene-butyl]azanium iodide

Systemtic Name: trimethyl-[2-(4-methylphenyl)-3-oxidanylidene-butyl]azanium iodide Openeye Name: trimethyl-[3-oxo-2-(p-tolyl)butyl]ammonium iodide CAS Name: trimethyl-[2-(4-methylphenyl)-3-oxobutyl]ammonium iodide IUPAC Name: trimethyl-[2-(4-methylphenyl)-3-oxobutyl]azanium iodide Traditional Name: [3-keto-2-(p-tolyl)butyl]-trimethyl-ammonium iodide Formula: C14H22INO MolecularWeight: 347.23505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[N+](C)(C)C)C(=O)C.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C[N+](C)(C)C)C(=O)C.[I-]

InChI

InChI=1S/C14H22NO.HI/c1-11-6-8-13(9-7-11)14(12(2)16)10-15(3,4)5;/h6-9,14H,10H2,1-5H3;1H/q+1;/p-1